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XCEvaluatorUnrestricted Member List

This is the complete list of members for XCEvaluatorUnrestricted, including all inherited members.

aoMapXCEvaluatorprotected
bisOrigXCEvaluatorprotected
bisPermutedXCEvaluatorprotected
dMatXCEvaluatorUnrestrictedprivate
getXC(int nElectrons, symmMatrix &xcA, symmMatrix &xcB, real *xcEnergy, int nThreads) constXCEvaluatorUnrestricted
gssXCEvaluatorprotected
integralInfoXCEvaluatorprotected
molXCEvaluatorprotected
patternXCEvaluatorprotected
permutationHMLXCEvaluatorprotected
XCEvaluator(const BasisInfoStruct &bisOrig_, const IntegralInfo &integralInfo_, const Molecule &mol_, const Dft::GridParams &gss_, std::vector< int > const &permutationHML_, const symmMatrix &dens)XCEvaluator
XCEvaluatorUnrestricted(const BasisInfoStruct &bisOrig_, const IntegralInfo &integralInfo_, const Molecule &mol_, const Dft::GridParams &gss_, std::vector< int > const &permutationHML_, const symmMatrix &densA, const symmMatrix &densB)XCEvaluatorUnrestrictedinline
~XCEvaluator()XCEvaluator
~XCEvaluatorUnrestricted()XCEvaluatorUnrestrictedinline